Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-
TL;DR: Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- (CAS 73680-56-5) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-phenyl-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid;hydrate
Also Known As: L-N-Cinnamoyl-3-phenylalanine hydrate, ALANINE, N-CINNAMOYL-3-PHENYL-, HYDRATE, L-, L-Phenylalanine, N-(1-oxo-3-phenyl-2-propenyl)-, monohydrate, (2S)-3-phenyl-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid hydrate, RefChem:1076307
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 1.6872 |
| Topological Polar Surface Area | 97.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 653.2365 |
Chemical Identifiers
| CAS Number | 73680-56-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)/C=C/C2=CC=CC=C2.O |
Product Overview
Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- (CAS 73680-56-5), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: (2S)-3-phenyl-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid;hydrate.
Chemical Property Profile of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-
Property Insights of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-
The XLogP value of 1.6872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-. Following Lipinski's Rule of Five, Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-?
The CAS number of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- is 73680-56-5.
What is the molecular formula of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-?
The molecular formula of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- is C18H19NO4.
What is the molecular weight of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-?
The molecular weight of Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- is 313.13 g/mol.
Where can I buy Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-?
You can request a quote for Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-cinnamoyl-3-phenyl-, hydrate, L-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-cinnamoyl-3-phenyl-, hydrate, L- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.